Chemical Properties of Fumaric acid, decyl 2,3,5-trichlorophenyl ester

Fumaric acid, decyl 2,3,5-trichlorophenyl ester

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InChI
InChI=1S/C20H25Cl3O4/c1-2-3-4-5-6-7-8-9-12-26-18(24)10-11-19(25)27-17-14-15(21)13-16(22)20(17)23/h10-11,13-14H,2-9,12H2,1H3/b11-10+
InChI Key
LWPBKWZRDHPSKM-ZHACJKMWSA-N
Formula
C20H25Cl3O4
SMILES
CCCCCCCCCCOC(=O)C=CC(=O)Oc1cc(Cl)cc(Cl)c1Cl
Molecular Weight1
435.77
Sources

Physical Properties

Property Value Unit Source
Δf -222.37 kJ/mol Joback Calculated Property
Δfgas -673.61 kJ/mol Joback Calculated Property
Δfus 58.80 kJ/mol Joback Calculated Property
Δvap 95.80 kJ/mol Joback Calculated Property
logPoct/wat 6.79 Crippen Calculated Property
Pc 1258.37 kPa Joback Calculated Property
Tboil 967.65 K Joback Calculated Property
Tc 1189.54 K Joback Calculated Property
Tfus 608.14 K Joback Calculated Property
Vc 1.22 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 922.06 J/mol×K 967.65 Joback Calculated Property
η 0.00 Pa×s 967.65 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 2
-CH3 1
=CH- (ring) 2
=C< (ring) 4
-CH2- 9
-Cl 3
=CH- 2
>C=O (nonring) 2

Similar Compounds

Fumaric acid, octyl 2,3,6-trichlorophenyl ester. Fumaric acid, decyl 2,3,6-trichlorophenyl ester. Fumaric acid, nonyl 2,3,6-trichlorophenyl ester. Fumaric acid, hexyl 2,3,5,6-tetrachlorophenyl ester. Fumaric acid, hexyl 2,3,6-trichlorophenyl ester. Fumaric acid, isohexyl 2,3,5-trichlorophenyl ester. Fumaric acid, pentyl 2,3,5,6-tetrachlorophenyl ester. Fumaric acid, butyl 2,3,5-trichlorophenyl ester. Fumaric acid, pentyl 2,3,6-trichlorophenyl ester. Fumaric acid, isohexyl 2,3,6-trichlorophenyl ester. Fumaric acid, hexyl 2,3,4,5-tetrachlorophenyl ester. Fumaric acid, heptyl 2,3,4,6-tetrachlorophenyl ester. Fumaric acid, nonyl 2,3,4,6-tetrachlorophenyl ester. Fumaric acid, 2,3,4,6-tetrachlorophenyl undecyl ester. Fumaric acid, dodecyl 2,3,4,6-tetrachlorophenyl ester.

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